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101810-73-5 | Pyrido[2,3-d]pyrimidine-6-carbonitrile, 2,4-diamino-5-methyl-
CAS No: 101810-73-5 Catalog No: AG0005M0 MDL No:
Product Description
Catalog Number:
AG0005M0
Chemical Name:
Pyrido[2,3-d]pyrimidine-6-carbonitrile, 2,4-diamino-5-methyl-
CAS Number:
101810-73-5
Molecular Formula:
C9H8N6
Molecular Weight:
200.2000
IUPAC Name:
2,4-diamino-5-methylpyrido[2,3-d]pyrimidine-6-carbonitrile
InChI:
InChI=1S/C9H8N6/c1-4-5(2-10)3-13-8-6(4)7(11)14-9(12)15-8/h3H,1H3,(H4,11,12,13,14,15)
InChI Key:
NBFQHQOVUVTNSM-UHFFFAOYSA-N
SMILES:
N#Cc1cnc2c(c1C)c(N)nc(n2)N
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.081g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
200.205g/mol
Monoisotopic Mass:
200.081g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
115A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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